(3S)-N-(4-bromanyl-3-methyl-phenyl)-1-(2,6-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(4-bromanyl-3-methyl-phenyl)-1-(2,6-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(4-bromo-3-methyl-phenyl)-1-(2,6-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(4-bromo-3-methylphenyl)-1-(2,6-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(4-bromo-3-methylphenyl)-1-(2,6-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-(4-bromo-3-methyl-phenyl)-1-(2,6-dimethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C20H21BrN2O2 MolecularWeight: 401.29694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CC(CC2=O)C(=O)NC3=CC(=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C[C@H](CC2=O)C(=O)NC3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C20H21BrN2O2/c1-12-5-4-6-13(2)19(12)23-11-15(10-18(23)24)20(25)22-16-7-8-17(21)14(3)9-16/h4-9,15H,10-11H2,1-3H3,(H,22,25)/t15-/m0/s1